4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide

C24H20N4O4S — CID 37315990

IUPAC4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3cccc(Oc4cnccn4)c3)cc2)cc1
InChIInChI=1S/C24H20N4O4S/c1-17-5-9-19(10-6-17)28-33(30,31)22-11-7-18(8-12-22)24(29)27-20-3-2-4-21(15-20)32-23-16-25-13-14-26-23/h2-16,28H,1H3,(H,27,29)
InChIKeyIFXRKKKRXVAACH-UHFFFAOYSA-N
MW460.52 g/mol
LogP4.63
Rot. Bonds7

About 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide

4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide (PubChem CID 37315990) has the molecular formula C24H20N4O4S and a molecular weight of 460.52 g/mol. Its IUPAC name is 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide
PubChem CID37315990
Molecular FormulaC24H20N4O4S
Molecular Weight460.52 g/mol
Exact Mass460.12
IUPAC Name4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide
SMILESCc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3cccc(Oc4cnccn4)c3)cc2)cc1
InChIInChI=1S/C24H20N4O4S/c1-17-5-9-19(10-6-17)28-33(30,31)22-11-7-18(8-12-22)24(29)27-20-3-2-4-21(15-20)32-23-16-25-13-14-26-23/h2-16,28H,1H3,(H,27,29)
InChIKeyIFXRKKKRXVAACH-UHFFFAOYSA-N
XLogP4.63
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.52
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide?
The IUPAC name of 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide (CID 37315990) is 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide.
What is the SMILES notation for 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide?
The canonical SMILES for 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide is Cc1ccc(NS(=O)(=O)c2ccc(C(=O)Nc3cccc(Oc4cnccn4)c3)cc2)cc1.
What is the InChIKey of 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide?
The InChIKey is IFXRKKKRXVAACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O4S/c1-17-5-9-19(10-6-17)28-33(30,31)22-11-7-18(8-12-22)24(29)27-20-3-2-4-21(15-20)32-23-16-25-13-14-26-23/h2-16,28H,1H3,(H,27,29).
What are the key properties of 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide?
4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide has a molecular weight of 460.52 g/mol, XLogP of 4.63, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methylphenyl)sulfamoyl]-N-(3-pyrazin-2-yloxyphenyl)benzamide is sourced from PubChem (CID 37315990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).